AG01DTI3

1391373-95-7 | methyl 2-[(1R)-1-aminoethyl]benzoate hydrochloride

AG01DTI3

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CAS Number	1391373-95-7
Catalog Number	AG01DTI3
Chemical Name	methyl 2-[(1R)-1-aminoethyl]benzoate hydrochloride
IUPAC Name	methyl 2-[(1R)-1-aminoethyl]benzoate;hydrochloride
InChI	InChI=1S/C10H13NO2.ClH/c1-7(11)8-5-3-4-6-9(8)10(12)13-2;/h3-7H,11H2,1-2H3;1H/t7-;/m1./s1
InChI Key	ULMRKIOVDPKQKH-OGFXRTJISA-N
MDL Number	MFCD12910776
Molecular Formula	C10H14ClNO2
Molecular Weight	215.6767
SMILES	O=C(C1=CC=CC=C1[C@@H](C)N)OC.[H]Cl
Synonyms	1391373-95-7, METHYL 2-[(1R)-1-AMINOETHYL]BENZOATE HYDROCHLORIDE,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	215.071g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	215.677g/mol
Monoisotopic Mass	215.071g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302-H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code	\N

Certificate of Analysis

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